Geometry & MOs

Info

ID:	83100
PubChem CID:	49857146
Reduced:	BrNO3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	337.06774
ΔH_f, kcal/mol:	-106.32
Dipole, Da:	4.01
IP(EA), eV:	-8.87(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1'-propylspiro[chromene-2,4'-piperidine]-7-ol

Drug info:

PubChemData

Smile

CC(=O)N1CCC2(CC1)C(=CC3=C(O2)C=C(C=C3)O)Br

DOS

IR

Vibrations